ethyl 5-carbamoyl-4-methyl-2-{[2-(4-methylphenyl)quinoline-4-carbonyl]amino}thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-carbamoyl-4-methyl-2-{[2-(4-methylphenyl)quinoline-4-carbonyl]amino}thiophene-3-carboxylate
ethyl 5-carbamoyl-4-methyl-2-{[2-(4-methylphenyl)quinoline-4-carbonyl]amino}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-1128 |
| Compound Name: | ethyl 5-carbamoyl-4-methyl-2-{[2-(4-methylphenyl)quinoline-4-carbonyl]amino}thiophene-3-carboxylate |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C26 H23 N3 O4 S |
| Smiles: | CCOC(c1c(C)c(C(N)=O)sc1NC(c1cc(c2ccc(C)cc2)nc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0394 |
| logD: | 2.257 |
| logSw: | -4.9652 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.996 |
| InChI Key: | GTFIOIYXKPDRHU-UHFFFAOYSA-N |